SCHEMBL10232013

SCHEMBL10232013

CC(C)CN1C[C@H](CCCB(O)O)[C@H](C(=O)O)C1

nearest known ligand 0.52

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ARG1 P05089 20/20 0.52
ARG2 P78540 7/20 0.52

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL22524572 1.00 ARG1 (0.52) ARG1ARG2
SCHEMBL23586249 0.87 ARG1 (0.40) ARG1ARG2
SCHEMBL4449212 0.84 ARG1 (0.46) ARG1ARG2
SCHEMBL17506559 0.83 ARG1 (0.34) ARG1ARG2
SCHEMBL20331801 0.82 ARG1 (0.44) ARG1ARG2
SCHEMBL10229362 0.79 ARG1 (0.52) ARG1ARG2
SCHEMBL21906656 0.79 ARG1 (0.52) ARG1ARG2
SCHEMBL22524616 0.79 ARG1 (0.37) ARG1ARG2
SCHEMBL18813958 0.78 ARG1 (0.41) ARG1ARG2
SCHEMBL21902889 0.78 ARG1 (0.49) ARG1ARG2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3034509-B1 ARGINASE INHIBITORS AS THERAPEUTICS MARS INC (US) 2020-04-22 EP disclosed
WO-2012058065-A1 BORONATES AS ARGINASE INHIBITORS MARS INCORPORATED (US) 2012-05-03 WO disclosed